SCHEMBL487231

SCHEMBL487231

COC(OC)(OC)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.48
CES1 P23141 1/20 0.45
KCNN4 O15554 5/20 0.44
ALDH1A1 P00352 3/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 2/20 0.41
CA4 P22748 2/20 0.41
TAAR1 Q96RJ0 1/20 0.39
CYP2B6 P20813 1/20 0.38
ESR1 P03372 2/20 0.37
ESR2 Q92731 2/20 0.37
CYP3A4 P08684 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6270358 0.89 MAPK1 (0.44) MAPK1CES1KCNN4ALDH1A1ALOX15
SCHEMBL7056377 0.85 MAPK1 (0.41) MAPK1CES1KCNN4ALDH1A1ALOX15
SCHEMBL11302190 0.81 ALDH1A1 (0.50) MAPK1CES1KCNN4ALDH1A1ALOX15
SCHEMBL28528178 0.81 KCNN4 (0.39) MAPK1CES1KCNN4ALDH1A1ALOX15
SCHEMBL8032767 0.81 CES1 (0.41) MAPK1CES1KCNN4ALDH1A1ALOX15
SCHEMBL11781678 0.81 CA4 (0.42) MAPK1CES1KCNN4ALDH1A1ALOX15
SCHEMBL9576889 0.81 KCNN4 (0.35) MAPK1CES1KCNN4ALDH1A1ALOX15
SCHEMBL30655989 0.79 PTPN1 (0.47) MAPK1ALDH1A1CYP2B6CYP3A4
SCHEMBL628803 0.79 CES1 (0.40) MAPK1CES1KCNN4ALDH1A1ALOX15
SCHEMBL2341249 0.79 CES1 (0.48) MAPK1CES1KCNN4ALDH1A1ALOX15

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 987 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119613414-A Non-azolanet Process for the preparation of tam 上海皓元医药股份有限公司 2025-03-14 CN claimed
EP-3925948-B1 INTERMEDIATE OF ERIBULIN, SYNTHESIS METHOD THEREFOR AND USE THEREOF BEIJING TIENYI LUFU PHARMATECH CO LTD (CN) 2024-08-07 EP claimed
US-20240051920-A1 AN IMPROVED HIGHLY EFFICIENT PROCESS FOR THE PREPARATION OF NINTEDANIB AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF BDR LIFESCIENCES PRIVATE LIMITED (IN) 2024-02-15 US claimed
CN-117486966-A Method for synthesizing brassinolide 山东成武泽大泛科化工有限公司 2024-02-02 CN claimed
CN-117219855-A Sodium ion battery electrolyte and sodium ion battery 山东立中新能源材料有限公司 2023-12-12 CN claimed
CN-111465594-B Synthesis of 2-indolinones known as intermediates for the preparation of Nidamibu 费米有限公司 2023-11-07 CN claimed
EP-3276696-B1 FUNCTIONAL LAYER FORMING COMPOSITION AND METHOD FOR MANUFACTURING THE SAME SEIKO EPSON CORP (JP) 2023-10-11 EP claimed
CN-111662223-B Indolinone derivatives and process for preparing intermediates thereof 四川科伦药物研究院有限公司 2023-07-14 CN claimed
CN-111848369-B Eribulin intermediate and synthesis method and application thereof 北京天一绿甫医药科技有限公司 2023-06-30 CN claimed
WO-2023103137-A1 ORTHOESTER MIXTURE PHARMACEUTICAL EXCIPIENT, PREPARATION METHOD, AND TOPICAL SUSTAINED-RELEASE DRUG DELIVERY PREPARATION CONTAINING EXCIPIENT 安徽大学 2023-06-15 WO claimed
US-5807912-A PURIFICATION; HEATING GENERAL ELECTRIC COMPANY (US) 1998-09-15 US claimed
EP-0834525-A2 Ortho esters as bisphenol A scavenger in polycarbonate product GENERAL ELECTRIC COMPANY (US) 1998-04-08 EP claimed
EP-0606710-B1 Photochemical generation of dyes MINNESOTA MINING & MFG (US) 1997-10-08 EP claimed
US-5389498-A Photosensitive element for production of near infrared absorbing images; magnetic recording media MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-02-14 US claimed
EP-0606710-A2 Photochemical generation of dyes MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-07-20 EP claimed
EP-0315464-B1 STABILIZED ISOTHIAZOLONE COMPOSITIONS ROHM AND HAAS COMPANY (US) 1993-01-27 EP claimed
US-4906274-A Organic stabilizers ROHM AND HAAS COMPANY (US) 1990-03-06 US claimed
EP-0315464-A1 Stabilized isothiazolone compositions ROHM AND HAAS COMPANY (US) 1989-05-10 EP claimed
CN-86100772-A 2,3-dimethoxy-5-methyl isophthalic acid, 4-benzoquinones synthetic method 1987-01-31 CN claimed
US-4252738-A 1,2-Halohydrincarboxylic acid esters and a process for their preparation BAYER AKTIENGESELLSCHAFT (DE) 1981-02-24 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240051920-A1 AN IMPROVED HIGHLY EFFICIENT PROCESS FOR THE PREPARATION OF NINTEDANIB AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF JAK1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, INMT MAPK1 847/4885CES1 3411/4885KCNN4 1729/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.